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BDBM88792 3-chloranyl-N-[4-[[(E)-pyridin-3-ylmethylideneamino]carbamoyl]phenyl]benzamide::3-chloro-N-[4-[[(E)-3-pyridylmethyleneamino]carbamoyl]phenyl]benzamide::3-chloro-N-[4-[[(E)-pyridin-3-ylmethylideneamino]carbamoyl]phenyl]benzamide::3-chloro-N-[4-[oxo-[(2E)-2-(3-pyridinylmethylidene)hydrazinyl]methyl]phenyl]benzamide::MLS000912241::SMR000619847::cid_46496241

SMILES: Clc1cccc(c1)C(=O)Nc1ccc(cc1)C(=O)N\N=C\c1cccnc1

InChI Key: InChIKey=PQVVWBFGJPIWQJ-YDZHTSKRSA-N

Data: 7 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 88792   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Thrombin


(Bos taurus (Bovine))
BDBM88792
PNG
(3-chloranyl-N-[4-[[(E)-pyridin-3-ylmethylideneamin...)
Show SMILES Clc1cccc(c1)C(=O)Nc1ccc(cc1)C(=O)N\N=C\c1cccnc1
Show InChI InChI=1S/C20H15ClN4O2/c21-17-5-1-4-16(11-17)19(26)24-18-8-6-15(7-9-18)20(27)25-23-13-14-3-2-10-22-12-14/h1-13H,(H,24,26)(H,25,27)/b23-13+
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford Burnham Medical Research Institute (SBMRI, La Jolla, CA...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2JM286J
More data for this
Ligand-Target Pair
tyrosine-protein phosphatase non-receptor type 5 isoform a


(Homo sapiens (Human))
BDBM88792
PNG
(3-chloranyl-N-[4-[[(E)-pyridin-3-ylmethylideneamin...)
Show SMILES Clc1cccc(c1)C(=O)Nc1ccc(cc1)C(=O)N\N=C\c1cccnc1
Show InChI InChI=1S/C20H15ClN4O2/c21-17-5-1-4-16(11-17)19(26)24-18-8-6-15(7-9-18)20(27)25-23-13-14-3-2-10-22-12-14/h1-13H,(H,24,26)(H,25,27)/b23-13+
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KEGG

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n/an/a 1.65E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2DV1HGT
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (Human))
BDBM88792
PNG
(3-chloranyl-N-[4-[[(E)-pyridin-3-ylmethylideneamin...)
Show SMILES Clc1cccc(c1)C(=O)Nc1ccc(cc1)C(=O)N\N=C\c1cccnc1
Show InChI InChI=1S/C20H15ClN4O2/c21-17-5-1-4-16(11-17)19(26)24-18-8-6-15(7-9-18)20(27)25-23-13-14-3-2-10-22-12-14/h1-13H,(H,24,26)(H,25,27)/b23-13+
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n/an/a 2.84E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2959G44
More data for this
Ligand-Target Pair
Hematopoietic cell protein-tyrosine phosphatase 70Z-PEP


(Homo sapiens (Human))
BDBM88792
PNG
(3-chloranyl-N-[4-[[(E)-pyridin-3-ylmethylideneamin...)
Show SMILES Clc1cccc(c1)C(=O)Nc1ccc(cc1)C(=O)N\N=C\c1cccnc1
Show InChI InChI=1S/C20H15ClN4O2/c21-17-5-1-4-16(11-17)19(26)24-18-8-6-15(7-9-18)20(27)25-23-13-14-3-2-10-22-12-14/h1-13H,(H,24,26)(H,25,27)/b23-13+
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n/an/a 3.02E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2FQ9V6B
More data for this
Ligand-Target Pair
26S Proteasome regulatory subunit Rpn11 (Rpn11)


(Homo sapiens (Human))
BDBM88792
PNG
(3-chloranyl-N-[4-[[(E)-pyridin-3-ylmethylideneamin...)
Show SMILES Clc1cccc(c1)C(=O)Nc1ccc(cc1)C(=O)N\N=C\c1cccnc1
Show InChI InChI=1S/C20H15ClN4O2/c21-17-5-1-4-16(11-17)19(26)24-18-8-6-15(7-9-18)20(27)25-23-13-14-3-2-10-22-12-14/h1-13H,(H,24,26)(H,25,27)/b23-13+
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n/an/a 2.27E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford Burnham Medical Research Institute (SBMRI, La Jolla, CA...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2PC30Z9
More data for this
Ligand-Target Pair
tyrosine-protein phosphatase non-receptor type 5 isoform a


(Homo sapiens (Human))
BDBM88792
PNG
(3-chloranyl-N-[4-[[(E)-pyridin-3-ylmethylideneamin...)
Show SMILES Clc1cccc(c1)C(=O)Nc1ccc(cc1)C(=O)N\N=C\c1cccnc1
Show InChI InChI=1S/C20H15ClN4O2/c21-17-5-1-4-16(11-17)19(26)24-18-8-6-15(7-9-18)20(27)25-23-13-14-3-2-10-22-12-14/h1-13H,(H,24,26)(H,25,27)/b23-13+
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n/an/a 4.56E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2KH0KWR
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 11


(Homo sapiens (Human))
BDBM88792
PNG
(3-chloranyl-N-[4-[[(E)-pyridin-3-ylmethylideneamin...)
Show SMILES Clc1cccc(c1)C(=O)Nc1ccc(cc1)C(=O)N\N=C\c1cccnc1
Show InChI InChI=1S/C20H15ClN4O2/c21-17-5-1-4-16(11-17)19(26)24-18-8-6-15(7-9-18)20(27)25-23-13-14-3-2-10-22-12-14/h1-13H,(H,24,26)(H,25,27)/b23-13+
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n/an/a 5.05E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2T43RPN
More data for this
Ligand-Target Pair